Cas no 23149-44-2 (Butanamide,N-(4-benzoylphenyl)-3-oxo-)
23149-44-2 structure
Product Name:Butanamide,N-(4-benzoylphenyl)-3-oxo-
CAS No:23149-44-2
MF:C17H15NO3
MW:281.305904626846
CID:283871
PubChem ID:284003
Update Time:2025-04-19
Butanamide,N-(4-benzoylphenyl)-3-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Butanamide,N-(4-benzoylphenyl)-3-oxo-
- NSC139468
- DTXSID40945825
- NSC-139468
- 23149-44-2
- n-(4-benzoylphenyl)-3-oxobutanamide
-
- Inchi： 1S/C17H15NO3/c1-12(19)11-16(20)18-15-9-7-14(8-10-15)17(21)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,20)
- InChI Key： SFGBUXYWBBNHEK-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)C1C=CC(=CC=1)NC(CC(C)=O)=O
Computed Properties
- Exact Mass: 281.10525
- Monoisotopic Mass: 281.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 391
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 63.2?2
Experimental Properties
- Density: 1.219
- Boiling Point: 514.2°C at 760 mmHg
- Flash Point: 198.3°C
- Refractive Index: 1.606
- PSA: 63.24
- LogP: 2.90820
Butanamide,N-(4-benzoylphenyl)-3-oxo- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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